3-(1-phenyl-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1-phenyl-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl)-2H-1-benzopyran-2-one
3-(1-phenyl-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K241-0241 |
| Compound Name: | 3-(1-phenyl-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 320.37 |
| Molecular Formula: | C18 H12 N2 O2 S |
| Smiles: | C1=C(C2=CN(C(N2)=S)c2ccccc2)C(=O)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.0804 |
| logD: | 3.0343 |
| logSw: | -3.5742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.32 |
| InChI Key: | PQLXBUALUZFSAJ-UHFFFAOYSA-N |